2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]ethanamide

Systemtic Name: 2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]ethanamide Openeye Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]acetamide IUPAC Name: N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C27H23N5O2 MolecularWeight: 449.50382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)CNC(=O)CC4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)CNC(=O)CC4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C27H23N5O2/c33-25(15-24-22-13-7-8-14-23(22)27(34)30-29-24)28-16-21-18-32(17-19-9-3-1-4-10-19)31-26(21)20-11-5-2-6-12-20/h1-14,18H,15-17H2,(H,28,33)(H,30,34)